SCHEMBL8049846

SCHEMBL8049846

C=CCCC1=CCC(C2CCC(CCC3CCC(CCC)CC3)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8037716 0.99 TLR4 (0.36) TLR4
SCHEMBL8037934 0.92 TLR4 (0.34) TLR4
SCHEMBL8037737 0.90 CYP3A4 (0.30) TLR4
SCHEMBL8047757 0.87 MAOA (0.38)
SCHEMBL8052561 0.86 TLR4 (0.38) TLR4
SCHEMBL8052563 0.86 TLR4 (0.38) TLR4
SCHEMBL7907385 0.84 TLR4 (0.41) TLR4
SCHEMBL7907380 0.84 TLR4 (0.41) TLR4
SCHEMBL8049177 0.84 TSHR (0.34)
SCHEMBL8049101 0.84 THRB (0.34)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0728829-B1 Liquid crystalline alkenylcyclohexene derivative, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 2000-05-03 EP disclosed
US-5698136-A LOW TEMPERATURE COMPATIBILITY, CHEMICAL STABILITY CHISSO CORPORATION (JP) 1997-12-16 US disclosed
EP-0728829-A2 Liquid crystalline alkenylcyclohexene derivative, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1996-08-28 EP disclosed